299 research outputs found
Medical applications of EPR
Selected applications of continuous-wave EPR in medicine are reviewed. This includes detection of reactive oxygen and nitrogen species, pH measurements and oxymetry. Applications of EPR imaging are demonstrated on selected examples and future developments to faster imaging methods are discussed
Diffusion pathways of hydrogen across the steps of a vicinal Si(001) surface
Hydrogen diffusion across DB steps on Si(001) surfaces is investigated by means of variable-temperature scanning tunneling microscopy and first-principles calculations. Experimentally, the hopping rate for diffusion from the step sites to the Si dimers of the upper terrace was found to be more than one order of magnitude higher than that for diffusion to the lower terrace. This clear preference, opposite to the trend for the respective binding energies, is explained by first-principles calculations that identify a metastable intermediate to be responsible for the unexpected lowering of the energy barrier for upward diffusion
Quantum Monte Carlo calculations of H dissociation on Si(001)
We present quantum Monte Carlo calculations for various reaction pathways of
H with Si(001), using large model clusters of the surface. We obtain
reaction energies and energy barriers noticeably higher than those from
approximate exchange-correlation functionals. In improvement over previous
studies, our adsorption barriers closely agree with experimental data. For
desorption, the calculations give barriers for conventional pathways in excess
of the presently accepted experimental value, and pinpoint the role of coverage
effects and desorption from steps.Comment: 4 pages, 1 figur
Highly site-specific H2 adsorption on vicinal Si(001) surfaces
Experimental and theoretical results for the dissociative adsorption of H_2
on vicinal Si(001) surfaces are presented. Using optical second-harmonic
generation, sticking probabilities at the step sites are found to exceed those
on the terraces by up to six orders of magnitude. Density functional theory
calculations indicate the presence of direct adsorption pathways for
monohydride formation but with a dramatically lowered barrier for step
adsorption due to an efficient rehybridization of dangling orbitals.Comment: 5 pages, 4 figures, submitted to Phys. Rev. Lett. (1998). Other
related publications can be found at
http://www.fhi-berlin.mpg.de/th/paper.htm
Molekulare Analyse der metabolischen Resistenz in Acker-Fuchsschwanz
Um Kandidatengene für die metabolische Herbizid-Resistenz zu erfassen, wurde mithilfe eines „Transcriptomics“-Ansatz ein quantitativer Vergleich der Genexpression zwischen sensitiven und resistenten Biotypen des Acker-Fuchsschwanzs (ALOMY) durchgeführt. Ausgehend von einem metabolisch resistenten Biotyp wurde im ersten Schritt mithilfe eines „paired-end“ RNA-Seq Protokolls ein Referenz-Transkriptom für ALOMY aus unbehandelten und Herbizid-behandelten Pflanzen erstellt. Im zweiten Schritt wurde die Genexpression in verschiedenen metabolisch resistenten ALOMY-Biotypen sowie in einer repräsentativen Auswahl an sensitiven Wildtyp-Biotypen mithilfe einer 3´-spezifischen RNA-Sequenzierung bestimmt und mit dem Referenztranskriptom abgeglichen. Durch Vergleich der Expressionshöhe einzelner Gene in Wildtyp und resistenten ALOMY Biotypen wurden Kandidatengene aus der Gruppe der Glutathion-Transferasen identifiziert. Weitere Analysen werden notwendig sein, um eine enge Korrelation mit der metabolischen Resistenz zu verifizieren. Stichwörter: ALOMY, Acker-Fuchsschwanz, Glutathion S-Transferase, MACE, metabolische Resistenz, Referenztranskriptom Molecular analysis of metabolic resistance in blackgrass Abstract A transcriptomics approach was chosen in order to determine candidate genes for metabolic herbicide resistance in a quantitative comparison of expressed genes in sensitive wild type and resistant blackgrass (Alopecurus myosuroides = ALOMY) plants. Firstly a reference transcriptome for blackgrass was established by means of a paired-end RNA-Seq protocol prepared from control and herbicide treated plants from a metabolic resistant biotype. Secondly gene expression was measured in different metabolic resistant ALOMY biotypes and a representative selection of sensitive wild type plants using a 3´-specific RNA sequencing strategy and related to the reference transcriptome. By comparing expression levels for individual genes in wild type and resistant blackgrass biotypes candidate genes from the group of glutathione transferases were identified. Further analyses will be necessary in order to verify a close correlation with the metabolic resistance. Keywords: ALOMY, blackgrass, MACE, non-target site resistance, reference transcriptome, RNA-Se
Cardiac rehabilitation in Austria: long term health-related quality of life outcomes
<p>Abstract</p> <p>Background</p> <p>The goal of cardiac rehabilitation programs is not only to prolong life but also to improve physical functioning, symptoms, well-being, and health-related quality of life (HRQL). The aim of this study was to document the long-term effect of a 1-month inpatient cardiac rehabilitation intervention on HRQL in Austria.</p> <p>Methods</p> <p>Patients (N = 487, 64.7% male, age 60.9 ± 12.5 SD years) after myocardial infarction, with or without percutaneous interventions, coronary artery bypass grafting or valve surgery underwent inpatient cardiac rehabilitation and were included in this long-term observational study (two years follow-up). HRQL was measured with both the MacNew Heart Disease Quality of Life Instrument [MacNew] and EuroQoL-5D [EQ-5D].</p> <p>Results</p> <p>All MacNew scale scores improved significantly (p < 0.001) and exceeded the minimal important difference (0.5 MacNew points) by the end of rehabilitation. Although all MacNew scale scores deteriorated significantly over the two year follow-up period (p < .001), all MacNew scale scores still remained significantly higher than the pre-rehabilitation values. The mean improvement after two years in the MacNew social scale exceeded the minimal important difference while MacNew scale scores greater than the minimal important difference were reported by 40-49% of the patients.</p> <p>Two years after rehabilitation the mean improvement in the EQ-5D Visual Analogue Scale score was not significant with no significant change in the proportion of patients reporting problems at this time.</p> <p>Conclusion</p> <p>These findings provide a first indication that two years following inpatient cardiac rehabilitation in Austria, the long-term improvements in HRQL are statistically significant and clinically relevant for almost 50% of the patients. Future controlled randomized trials comparing different cardiac rehabilitation programs are needed.</p
Electronic Structure of Titanylphthalocyanine Layers on Ag(111)
We have investigated the electronic structures of axially oxo functionalized titanylphthalocyanine (TiOPc) on Ag(111) by X-ray and ultraviolet photoelectron spectroscopies, two-photon photoemission, X-ray absorption spectroscopy, and X-ray magnetic circular dichroism. Furthermore, we use complementary data of TiOPc on graphite and planar copper phthalocyanine (CuPc) on Ag(111) for a comparative analysis. Both molecules adsorb on Ag(111) in a parallel orientation to the surface, for TiOPc with an oxygen-up configuration. The interaction of nitrogen and carbon atoms with the substrate is similar for both molecules, while the bonding of the titanium atom to Ag(111) in the monolayer is found to be slightly more pronounced than in the CuPc case. Ultraviolet photoemission spectroscopy reveals an occupation of the lowest unoccupied molecular orbital (LUMO) level in monolayer thick TiOPc on Ag(111) related to the interaction of the molecules and the silver substrate. This molecule-metal interaction also causes an upward shift of the Ag(111) Shockley state that is transformed into an unoccupied interface state with energies of 0.23 and 0.33 eV for the TiOPc monolayer and bilayer, respectively, at the Brillouin zone center
Dynamic image potential at an Al(111) surface
We evaluate the electronic self-energy Sigma(E) at an Al(111) surface using the GW space-time method. This self-energy automatically includes the image potential V-im not present in any local-density approximation for exchange and correlation. We solve the energy-dependent quasiparticle equations and calculate the effective local potential experienced by electrons in the near-surface region. The relative contribution of exchange proves to be very different for states above the Fermi level. The image-plane position for interacting electrons is closer to the surface than for the purely electrostatic effects felt by test charges, and, like its classical counterpart, is drawn inwards by the effects of atomic structure
Lifetimes of image-potential states on copper surfaces
The lifetime of image states, which represent a key quantity to probe the
coupling of surface electronic states with the solid substrate, have been
recently determined for quantum numbers on Cu(100) by using
time-resolved two-photon photoemission in combination with the coherent
excitation of several states (U. H\"ofer et al, Science 277, 1480 (1997)). We
here report theoretical investigations of the lifetime of image states on
copper surfaces. We evaluate the lifetimes from the knowledge of the
self-energy of the excited quasiparticle, which we compute within the GW
approximation of many-body theory. Single-particle wave functions are obtained
by solving the Schr\"odinger equation with a realistic one-dimensional model
potential, and the screened interaction is evaluated in the random-phase
approximation (RPA). Our results are in good agreement with the experimentally
determined decay times.Comment: 4 pages, 1 figure, to appear in Phys. Rev. Let
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